4-[Acetyl-[3-(Trifluoromethyl)Phenyl]Amino]Butanoic Acid
[CAS# 30544-58-2]

Identification

• Name: 4-[Acetyl-[3-(Trifluoromethyl)Phenyl]Amino]Butanoic Acid
• Synonyms: 4-[Acetyl-[3-(Trifluoromethyl)Phenyl]Amino]Butyric Acid; 4-[Ethanoyl-[3-(Trifluoromethyl)Phenyl]Amino]Butanoic Acid; 4-(N-(Alpha,Alpha,Alpha-Trifluoro-M-Tolyl)Acetamido)Butyric Acid
• Molecular Formula: C₁₃H₁₄F₃NO₃
• Molecular Weight: 289.25
• CAS Registry Number: 30544-58-2
• SMILES: C1=C(N(CCCC(O)=O)C(C)=O)C=CC=C1C(F)(F)F
• InChI: 1S/C13H14F3NO3/c1-9(18)17(7-3-6-12(19)20)11-5-2-4-10(8-11)13(14,15)16/h2,4-5,8H,3,6-7H2,1H3,(H,19,20)
• InChIKey: BHYIIPMHZNLRTN-UHFFFAOYSA-N

Properties

• Density: 1.323g/cm³ (Cal.)
• Boiling point: 414.172°C at 760 mmHg (Cal.)
• Flash point: 204.284°C (Cal.)